COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL064734
Chemical Name: (2E)-3-(2-chlorophenyl)-N-{[2-(piperidin-1-ylcarbonyl)phenyl]carbamothioyl}prop-2-enamide
Smiles: S=C(Nc1ccccc1C(=O)N1CCCCC1)NC(=O)/C=C/c1ccccc1Cl

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Molecular Weight: 427.95
Empirical Formula: C22H22ClN3O2S

Physical State: Dry powder
Available Amount: 176 mg

Lipinsky:
logP: 4.513
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 93
Number of rings: 3

     

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